SCHEMBL7288983

SCHEMBL7288983

O=C(CCCO)c1nc2cnccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 4/20 0.47
NAMPT P43490 1/20 0.37
KDM4E B2RXH2 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
DAO P14920 1/20 0.34
HPSE Q9Y251 1/20 0.34
FAAH O00519 2/20 0.34
MAPK14 Q16539 1/20 0.33
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
MPO P05164 1/20 0.32
ALDH1A1 P00352 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7355337 0.94 DAGLA (0.51) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7289513 0.94 DAGLA (0.51) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7296896 0.91 DAGLA (0.43) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7288980 0.89 DAGLA (0.47) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7289503 0.86 DAGLA (0.51) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7355327 0.86 DAGLA (0.51) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7296891 0.85 DAGLA (0.43) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7297473 0.85 DAGLA (0.39) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7297464 0.82 DAGLA (0.39) DAGLANAMPTKDM4ESMN1; SMN2PDE3B
SCHEMBL7352247 0.77 MPO (0.40) DAGLANAMPTKDM4ESMN1; SMN2PDE3B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed